CID 43655004

(2-amino-1-cyclopropylethyl)(benzyl)methylamine

Structural Information

Molecular Formula
C13H20N2
SMILES
CN(CC1=CC=CC=C1)C(CN)C2CC2
InChI
InChI=1S/C13H20N2/c1-15(13(9-14)12-7-8-12)10-11-5-3-2-4-6-11/h2-6,12-13H,7-10,14H2,1H3
InChIKey
WUZZCDOBFVDZCJ-UHFFFAOYSA-N
Compound name
N-benzyl-1-cyclopropyl-N-methylethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

204.16264 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.16992 143.7
[M+Na]+ 227.15186 149.6
[M-H]- 203.15536 151.5
[M+NH4]+ 222.19646 157.6
[M+K]+ 243.12580 147.2
[M+H-H2O]+ 187.15990 136.2
[M+HCOO]- 249.16084 168.7
[M+CH3COO]- 263.17649 197.9
[M+Na-2H]- 225.13731 148.4
[M]+ 204.16209 144.5
[M]- 204.16319 144.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.